Geometry & MOs

Info

ID:	422121
PubChem CID:	135117242
Reduced:	SN2O2C17H24 (1)
Stoich.:	AB2C2D17E24 (1)
Weight, g/mol:	289.215413
ΔH_f, kcal/mol:	-90.16
Dipole, Da:	1.94
IP(EA), eV:	-8.41(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl-[(2-methyl-1H-imidazol-5-yl)methyl]amino]ethanol

Drug info:

PubChemData

Smile

CSC1=CC=CC(=C1)NC(=O)N2CCC[C@@]3(C2)CCC[C@H]3O

DOS

IR

Vibrations